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CX-157

CAT: 0931-T15023-02Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0931-T15023-02Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
205187-53-7
Target
Monoamine Oxidase, MAO
Related Pathways
Neuroscience, Metabolism
Purity
0.9935
Bioactivity
CX-157 (KP 157) is a novel monoamine oxidase-A (MAO-A) inhibitor for the study of depression-like neurological disorders and cancer.
Smiles
O=S1(=O)C2=CC=C(F)C=C2OC3=CC(OCC(F)(F)F)=CC=C31
Molecular Formula
C14H8F4O4S
Molecular Weight
348.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Cx-157

CX157,3-fluoro-7-(2,2,2,-trifluoroethoxy)phenoxathiin-10,10-dioxide, is a reversible, selective inhibitor of MAO-A designed to have improved oral bioavailability and reduced clearance compared to previous MAO-A inhibitors of this class.

CAS Number205187-53-7
PubChem CID18687754
IUPAC Name3-fluoro-7-(2,2,2-trifluoroethoxy)phenoxathiine 10,10-dioxide
Molecular FormulaC14H8F4O4S
Molecular Weight348.27
XLogP3.5
Topological Polar Surface Area61
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity530
SMILES
C1=CC2=C(C=C1OCC(F)(F)F)OC3=C(S2(=O)=O)C=CC(=C3)F
InChI
InChI=1S/C14H8F4O4S/c15-8-1-3-12-10(5-8)22-11-6-9(21-7-14(16,17)18)2-4-13(11)23(12,19)20/h1-6H,7H2
InChIKey
PDIMOTRDGUQMNY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cx-157
CAS: 205187-53-7
CID: 18687754
Formula: C14H8F4O4S
MW: 348.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight348.27
XLogP33.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Exact Mass348.00794255
Monoisotopic Mass348.00794255
Topological Polar Surface Area61 Ų
Heavy Atom Count23
Formal Charge0
Complexity530
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes